Bhattacharyya, Mousumi (Date of defense: 2012-05-21)
Formation of a protein-ligand complex is opposed by the loss of rotational, translational and conformational degrees of freedom, but if the ligand binds in a conformation that does not corresponds to ...
Álvarez García, Daniel (Date of defense: 2014-12-18)
Computer-aided drug design is a key player in current drug discovery projects. Structure-based computational approaches use the target structural information to suggest potentially active and safe drugs. ...